7-azanyl-2-(cyanomethylsulfanyl)-[1,2,4]triazolo[1,5-a]pyrimidine-6-carbonitrile

Systemtic Name: 7-azanyl-2-(cyanomethylsulfanyl)-[1,2,4]triazolo[1,5-a]pyrimidine-6-carbonitrile Openeye Name: 7-amino-2-(cyanomethylsulfanyl)-[1,2,4]triazolo[1,5-a]pyrimidine-6-carbonitrile CAS Name: 7-amino-2-(cyanomethylthio)-[1,2,4]triazolo[1,5-a]pyrimidine-6-carbonitrile IUPAC Name: 7-amino-2-(cyanomethylsulfanyl)-[1,2,4]triazolo[1,5-a]pyrimidine-6-carbonitrile Traditional Name: 7-amino-2-(cyanomethylthio)-[1,2,4]triazolo[1,5-a]pyrimidine-6-carbonitrile Formula: C8H5N7S MolecularWeight: 231.2372

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Descriptors Computed from Structure

Canonical SMILES:

C1=NC2=NC(=NN2C(=C1C#N)N)SCC#N

Isomeric SMILES

C1=NC2=NC(=NN2C(=C1C#N)N)SCC#N

InChI

InChI=1S/C8H5N7S/c9-1-2-16-8-13-7-12-4-5(3-10)6(11)15(7)14-8/h4H,2,11H2